5-chloro-N-cyclopropyl-1,2,3,4-tetrahydronaphthalen-2-amine

C13H16ClN — CID 83838580

IUPAC5-chloro-N-cyclopropyl-1,2,3,4-tetrahydronaphthalen-2-amine
SMILESClc1cccc2c1CCC(NC1CC1)C2
InChIInChI=1S/C13H16ClN/c14-13-3-1-2-9-8-11(6-7-12(9)13)15-10-4-5-10/h1-3,10-11,15H,4-8H2
InChIKeyGOJXITSIBLHYGU-UHFFFAOYSA-N
MW221.73 g/mol
LogP2.95
Rot. Bonds2

About 5-chloro-N-cyclopropyl-1,2,3,4-tetrahydronaphthalen-2-amine

5-chloro-N-cyclopropyl-1,2,3,4-tetrahydronaphthalen-2-amine (PubChem CID 83838580) has the molecular formula C13H16ClN and a molecular weight of 221.73 g/mol. Its IUPAC name is 5-chloro-N-cyclopropyl-1,2,3,4-tetrahydronaphthalen-2-amine.

Molecular Properties

Compound Name5-chloro-N-cyclopropyl-1,2,3,4-tetrahydronaphthalen-2-amine
PubChem CID83838580
Molecular FormulaC13H16ClN
Molecular Weight221.73 g/mol
Exact Mass221.10
IUPAC Name5-chloro-N-cyclopropyl-1,2,3,4-tetrahydronaphthalen-2-amine
SMILESClc1cccc2c1CCC(NC1CC1)C2
InChIInChI=1S/C13H16ClN/c14-13-3-1-2-9-8-11(6-7-12(9)13)15-10-4-5-10/h1-3,10-11,15H,4-8H2
InChIKeyGOJXITSIBLHYGU-UHFFFAOYSA-N
XLogP2.95
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.73
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-chloro-N-cyclopropyl-2,3-dihydro-1H-inden-2-amine
CID 83834003
5-chloro-N-propyl-1,2,3,4-tetrahydronaphthalen-2-amine
CID 14969231
N-cyclopropyl-4-methyl-2,3-dihydro-1H-inden-2-amine
CID 83829023
N-(4-methylcyclohexyl)-1,2,3,4-tetrahydronaphthalen-2-amine
CID 43223234
4-[[(2S)-1,2,3,4-tetrahydronaphthalen-2-yl]amino]cyclohexan-1-ol
CID 26458443
4-[[(2R)-1,2,3,4-tetrahydronaphthalen-2-yl]amino]cyclohexan-1-ol
CID 26458441
4-chloro-N-ethyl-2,3-dihydro-1H-inden-2-amine
CID 23396987
(2R)-2-amino-1-(5-chloro-1,2,3,4-tetrahydronaphthalen-2-yl)propan-1-one
CID 178126498
4-(1,2,3,4-tetrahydronaphthalen-2-ylamino)cyclohexane-1-carboxamide
CID 43791690
N-cyclopropyl-1-azatetracyclo[7.6.1.05,16.010,15]hexadeca-5(16),6,8,10(15)-tetraen-12-amine
CID 84640227
(3R)-N-[(2S)-5-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl]thiolan-3-amine
CID 125138715
4-N-(2,3-dihydro-1H-inden-2-yl)cyclohexane-1,4-diamine
CID 62313141

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-cyclopropyl-1,2,3,4-tetrahydronaphthalen-2-amine?
The IUPAC name of 5-chloro-N-cyclopropyl-1,2,3,4-tetrahydronaphthalen-2-amine (CID 83838580) is 5-chloro-N-cyclopropyl-1,2,3,4-tetrahydronaphthalen-2-amine.
What is the SMILES notation for 5-chloro-N-cyclopropyl-1,2,3,4-tetrahydronaphthalen-2-amine?
The canonical SMILES for 5-chloro-N-cyclopropyl-1,2,3,4-tetrahydronaphthalen-2-amine is Clc1cccc2c1CCC(NC1CC1)C2.
What is the InChIKey of 5-chloro-N-cyclopropyl-1,2,3,4-tetrahydronaphthalen-2-amine?
The InChIKey is GOJXITSIBLHYGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16ClN/c14-13-3-1-2-9-8-11(6-7-12(9)13)15-10-4-5-10/h1-3,10-11,15H,4-8H2.
What are the key properties of 5-chloro-N-cyclopropyl-1,2,3,4-tetrahydronaphthalen-2-amine?
5-chloro-N-cyclopropyl-1,2,3,4-tetrahydronaphthalen-2-amine has a molecular weight of 221.73 g/mol, XLogP of 2.95, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-cyclopropyl-1,2,3,4-tetrahydronaphthalen-2-amine is sourced from PubChem (CID 83838580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).